SCHEMBL10020140

SCHEMBL10020140

CCCCCc1ccc(COc2ccc3c(c2F)C(F)C(F)c2c-3ccc(CCC)c2F)cc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRG P48443 2/20 0.36
S1PR1 P21453 1/20 0.33
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
HTT P42858 4/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
TSHR P16473 2/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX5 P09917 1/20 0.32
TYR P14679 1/20 0.32
ALOX15 P16050 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
SMPD1 P17405 1/20 0.31
CNR2 P34972 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10020116 0.92 S1PR1 (0.35) S1PR1CTSLCTSSCTSKHTT
SCHEMBL10019943 0.89 SMPD1 (0.38) CTSLCTSSCTSKHTTMAPT
SCHEMBL10020139 0.89 RXRG (0.39) RXRGCTSLCTSSCTSKHTT
SCHEMBL19621994 0.88 ABCB1 (0.39) RXRGS1PR1HTTMEN1KMT2A
SCHEMBL10020166 0.87 RXRG (0.35) RXRGCTSLCTSSCTSKRXRA
SCHEMBL19621962 0.87 CTSL (0.38) CTSLCTSSCTSKHTTMAPT
SCHEMBL10020135 0.87 CTSL (0.38) CTSLCTSSCTSKHTTMAPT
SCHEMBL10020009 0.86 HTT (0.34) S1PR1CTSLCTSSCTSKHTT
SCHEMBL10020036 0.86 S1PR1 (0.37) S1PR1HTTMAPTMEN1KMT2A
SCHEMBL10019632 0.85 CTSL (0.38) CTSLCTSSCTSKHTTMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2669263-B1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-11-22 EP disclosed
US-9193908-B2 Compound having dihydrophenanthrene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-9193908-B2 Compound having dihydrophenanthrene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-20130240784-A1 COMPOUND HAVING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130240784-A1 COMPOUND HAVING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-09-19 US disclosed
WO-2012086437-A1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY JNC株式会社 (JP) 2012-06-28 WO disclosed